diff --git a/qpms/symmetries.h b/qpms/symmetries.h index c3bc69a..1b7207b 100644 --- a/qpms/symmetries.h +++ b/qpms/symmetries.h @@ -5,9 +5,19 @@ * Here will be functions providing point group operations * operating on translation operators and T-matrices * as in tmatrices.py. + * + * At least I want: + * - Wigner D matrices + * - Basic mirror operations for T-matrices + * - Inversion operation for the translation matrices * * Maybe (much later) also point and space group irrep * functionality as in symmetries.py. + * However, I think that the group structures can be simply + * hard-coded/generated by a python script, then there is + * no need to check the group consistency etc. at runtime. + * + * */ #endif // SYMMETRIES_H